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{
"id": "mp-1208414",
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"structure_string": "Tb10 Ni4 Sb2\n1.0\n-3.828195 3.828195 6.673149\n3.828195 -3.828195 6.673149\n3.828195 3.828195 -6.673149\nTb Ni Sb\n10 4 2\ndirect\n0.000000 0.000000 0.000000 Tb\n0.500000 0.500000 0.000000 Tb\n0.799270 0.299270 0.822636 Tb\n0.200730 0.700730 0.177364 Tb\n0.476634 0.976634 0.177364 Tb\n0.299270 0.476634 0.500000 Tb\n0.023366 0.200730 0.500000 Tb\n0.523366 0.023366 0.822636 Tb\n0.700730 0.523366 0.500000 Tb\n0.976634 0.799270 0.500000 Tb\n0.123809 0.623809 0.747617 Ni\n0.876191 0.376191 0.252383 Ni\n0.623809 0.876191 0.500000 Ni\n0.376191 0.123809 0.500000 Ni\n0.250000 0.250000 0.000000 Sb\n0.750000 0.750000 0.000000 Sb\n",
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{
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"structure_string": "Zr36 V36 O8\n1.0\n4.401732 7.614793 0.000000\n-4.401732 7.614793 0.000000\n0.000000 0.012186 21.707447\nZr V O\n36 36 8\ndirect\n0.540488 0.540488 0.644965 Zr\n0.208518 0.208518 0.980035 Zr\n0.875189 0.875189 0.313153 Zr\n0.128318 0.128318 0.437962 Zr\n0.793793 0.793793 0.770464 Zr\n0.461339 0.461339 0.105609 Zr\n0.917252 0.540692 0.644955 Zr\n0.585071 0.205371 0.977444 Zr\n0.251381 0.874242 0.312780 Zr\n0.744697 0.128286 0.438161 Zr\n0.411946 0.792543 0.770596 Zr\n0.078003 0.458768 0.104287 Zr\n0.128286 0.744697 0.438161 Zr\n0.792543 0.411946 0.770596 Zr\n0.458768 0.078003 0.104287 Zr\n0.540692 0.917252 0.644955 Zr\n0.205371 0.585071 0.977444 Zr\n0.874242 0.251381 0.312780 Zr\n0.459512 0.459512 0.355035 Zr\n0.124811 0.124811 0.686847 Zr\n0.791482 0.791482 0.019965 Zr\n0.871683 0.871683 0.562038 Zr\n0.538661 0.538661 0.894391 Zr\n0.206207 0.206207 0.229536 Zr\n0.082748 0.459308 0.355045 Zr\n0.748619 0.125758 0.687220 Zr\n0.414929 0.794629 0.022556 Zr\n0.255303 0.871714 0.561839 Zr\n0.921997 0.541232 0.895713 Zr\n0.588054 0.207457 0.229404 Zr\n0.871714 0.255303 0.561839 Zr\n0.541232 0.921997 0.895713 Zr\n0.207457 0.588054 0.229404 Zr\n0.459308 0.082748 0.355045 Zr\n0.125758 0.748619 0.687220 Zr\n0.794629 0.414929 0.022556 Zr\n0.332821 0.332821 0.458626 V\n0.001520 0.001520 0.792029 V\n0.666780 0.666780 0.124181 V\n0.221252 0.221252 0.569397 V\n0.889784 0.889784 0.902577 V\n0.554871 0.554871 0.235350 V\n0.557316 0.221502 0.569044 V\n0.226651 0.885859 0.903009 V\n0.890435 0.554255 0.236399 V\n0.221502 0.557316 0.569044 V\n0.885859 0.226651 0.903009 V\n0.554255 0.890435 0.236399 V\n0.667179 0.667179 0.541374 V\n0.333220 0.333220 0.875819 V\n0.998480 0.998480 0.207971 V\n0.778748 0.778748 0.430603 V\n0.445129 0.445129 0.764650 V\n0.110216 0.110216 0.097423 V\n0.442684 0.778498 0.430956 V\n0.109565 0.445745 0.763601 V\n0.773349 0.114141 0.096991 V\n0.778498 0.442684 0.430956 V\n0.445745 0.109565 0.763601 V\n0.114141 0.773349 0.096991 V\n0.665270 0.665270 0.333465 V\n0.334730 0.334730 0.666535 V\n0.000000 0.000000 0.000000 V\n0.500000 0.500000 0.500000 V\n0.167037 0.167037 0.833582 V\n0.832963 0.832963 0.166418 V\n0.000000 0.500000 0.500000 V\n0.667475 0.165714 0.832598 V\n0.332525 0.834286 0.167402 V\n0.500000 0.000000 0.500000 V\n0.165714 0.667475 0.832598 V\n0.834286 0.332525 0.167402 V\n0.166486 0.166486 0.333566 O\n0.833514 0.833514 0.666434 O\n0.000000 0.500000 0.000000 O\n0.666434 0.166611 0.333533 O\n0.333566 0.833389 0.666467 O\n0.833389 0.333566 0.666467 O\n0.500000 0.000000 0.000000 O\n0.166611 0.666434 0.333533 O\n",
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{
"id": "mp-541007",
"created_at": "2022-09-04T14:44:29.298635Z",
"structure_string": "Ba4 Dy8 Mn4 O20\n1.0\n5.804153 0.000000 0.000000\n0.000000 7.213985 0.000000\n0.000000 0.000000 12.516565\nBa Dy Mn O\n4 8 4 20\ndirect\n0.250000 0.918604 0.899003 Ba\n0.750000 0.081396 0.100997 Ba\n0.750000 0.418604 0.600997 Ba\n0.250000 0.581396 0.399003 Ba\n0.250000 0.123009 0.293330 Dy\n0.750000 0.876991 0.706670 Dy\n0.750000 0.623009 0.206670 Dy\n0.250000 0.376991 0.793330 Dy\n0.250000 0.400124 0.074046 Dy\n0.750000 0.599876 0.925954 Dy\n0.750000 0.900124 0.425954 Dy\n0.250000 0.099876 0.574046 Dy\n0.250000 0.691983 0.652026 Mn\n0.750000 0.308017 0.347974 Mn\n0.750000 0.191983 0.847974 Mn\n0.250000 0.808017 0.152026 Mn\n0.001676 0.162248 0.434707 O\n0.501676 0.837752 0.565293 O\n0.998324 0.662248 0.065293 O\n0.498324 0.337752 0.934707 O\n0.998324 0.837752 0.565293 O\n0.498324 0.162248 0.434707 O\n0.001676 0.337752 0.934707 O\n0.501676 0.662248 0.065293 O\n0.498822 0.361690 0.224094 O\n0.998822 0.638310 0.775906 O\n0.501178 0.861690 0.275906 O\n0.001178 0.138310 0.724094 O\n0.501178 0.638310 0.775906 O\n0.001178 0.361690 0.224094 O\n0.498822 0.138310 0.724094 O\n0.998822 0.861690 0.275906 O\n0.250000 0.079338 0.101011 O\n0.750000 0.920662 0.898989 O\n0.750000 0.579338 0.398989 O\n0.250000 0.420662 0.601011 O\n",
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"density": 7.569631877395537,
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"formula_full": "Ba4 Dy8 Mn4 O20",
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{
"id": "mp-1029673",
"created_at": "2022-09-04T14:44:29.305194Z",
"structure_string": "K16 Cr16 N32\n1.0\n5.724646 0.000000 0.000000\n0.000000 11.484915 0.000000\n0.000000 0.000000 15.687762\nK Cr N\n16 16 32\ndirect\n0.248339 0.000048 0.432895 K\n0.748339 0.499952 0.567105 K\n0.751661 0.500048 0.067105 K\n0.251661 0.999952 0.932895 K\n0.751661 0.999952 0.567105 K\n0.251661 0.500048 0.432895 K\n0.248339 0.499952 0.932895 K\n0.748339 0.000048 0.067105 K\n0.353748 0.250922 0.307551 K\n0.853748 0.249078 0.692449 K\n0.646252 0.750922 0.192449 K\n0.146252 0.749078 0.807551 K\n0.646252 0.749078 0.692449 K\n0.146252 0.750922 0.307551 K\n0.353748 0.249078 0.807551 K\n0.853748 0.250922 0.192449 K\n0.747200 0.000772 0.315212 Cr\n0.247200 0.499228 0.684788 Cr\n0.252800 0.500772 0.184788 Cr\n0.752800 0.999228 0.815212 Cr\n0.252800 0.999228 0.684788 Cr\n0.752800 0.500772 0.315212 Cr\n0.747200 0.499228 0.815212 Cr\n0.247200 0.000772 0.184788 Cr\n0.815725 0.250783 0.441855 Cr\n0.315726 0.249217 0.558145 Cr\n0.184275 0.750783 0.058145 Cr\n0.684275 0.749217 0.941855 Cr\n0.184275 0.749217 0.558145 Cr\n0.684275 0.750783 0.441855 Cr\n0.815725 0.249217 0.941855 Cr\n0.315726 0.250783 0.058145 Cr\n0.117173 0.250656 0.471473 N\n0.617173 0.249344 0.528527 N\n0.882827 0.750656 0.028527 N\n0.382827 0.749344 0.971473 N\n0.882827 0.749344 0.528527 N\n0.382827 0.750656 0.471473 N\n0.117173 0.249344 0.971473 N\n0.617173 0.250656 0.028527 N\n0.758665 0.376692 0.381170 N\n0.258665 0.123308 0.618830 N\n0.241335 0.876692 0.118830 N\n0.741335 0.623308 0.881170 N\n0.241335 0.623308 0.618830 N\n0.741335 0.876692 0.381170 N\n0.758665 0.123308 0.881170 N\n0.258665 0.376692 0.118830 N\n0.760254 0.126461 0.379371 N\n0.260254 0.373540 0.620629 N\n0.239746 0.626460 0.120629 N\n0.739746 0.873540 0.879371 N\n0.239746 0.873540 0.620629 N\n0.739746 0.626460 0.379371 N\n0.760254 0.373540 0.879371 N\n0.260254 0.126461 0.120629 N\n0.506768 0.500051 0.248077 N\n0.006768 0.999949 0.751923 N\n0.493232 0.000051 0.251923 N\n0.993232 0.499949 0.748077 N\n0.493232 0.499949 0.751923 N\n0.993232 0.000051 0.248077 N\n0.506768 0.999949 0.748077 N\n0.006768 0.500051 0.251923 N\n",
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"formula_full": "K16 Cr16 N32",
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{
"id": "mp-1206080",
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"structure_string": "Zr2 Zn4 Ge2\n1.0\n-2.001446 2.001446 8.572971\n2.001446 -2.001446 8.572971\n2.001446 2.001446 -8.572971\nZr Zn Ge\n2 4 2\ndirect\n0.126104 0.126104 0.000000 Zr\n0.873896 0.873896 0.000000 Zr\n0.394735 0.394735 0.000000 Zn\n0.605265 0.605265 0.000000 Zn\n0.500000 0.000000 0.500000 Zn\n0.000000 0.500000 0.500000 Zn\n0.750000 0.250000 0.500000 Ge\n0.250000 0.750000 0.500000 Ge\n",
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},
{
"id": "mp-768221",
"created_at": "2022-09-04T14:44:29.337521Z",
"structure_string": "Y2 Bi2 O6\n1.0\n5.379383 -3.013329 0.000000\n5.379383 3.013329 0.000000\n3.691428 0.000000 4.938752\nY Bi O\n2 2 6\ndirect\n0.776544 0.776544 0.776544 Y\n0.276544 0.276544 0.276544 Y\n0.990232 0.990232 0.990232 Bi\n0.490232 0.490232 0.490232 Bi\n0.147863 0.590679 0.916271 O\n0.090679 0.647863 0.416271 O\n0.416271 0.090679 0.647863 O\n0.916271 0.147863 0.590679 O\n0.590679 0.916271 0.147863 O\n0.647863 0.416271 0.090679 O\n",
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},
{
"id": "mp-768808",
"created_at": "2022-09-04T14:44:29.320715Z",
"structure_string": "Li8 Al2 Cr6 O16\n1.0\n5.110866 0.000000 0.000000\n2.525017 7.337007 0.000000\n0.832987 0.875608 7.666190\nLi Al Cr O\n8 2 6 16\ndirect\n0.999882 0.687877 0.937473 Li\n0.000308 0.436787 0.686930 Li\n0.999692 0.563213 0.313070 Li\n0.000178 0.062698 0.810901 Li\n0.000336 0.185987 0.438459 Li\n0.000118 0.312123 0.062527 Li\n0.999664 0.814013 0.561541 Li\n0.999822 0.937302 0.189099 Li\n0.499861 0.123784 0.623725 Al\n0.500139 0.876216 0.376275 Al\n0.499840 0.373713 0.873673 Cr\n0.500000 0.500000 0.500000 Cr\n0.500160 0.626287 0.126327 Cr\n0.499934 0.247220 0.252929 Cr\n0.500066 0.752780 0.747071 Cr\n0.500000 0.000000 0.000000 Cr\n0.726807 0.536841 0.906370 O\n0.272513 0.589802 0.717445 O\n0.721703 0.668228 0.525676 O\n0.278382 0.210036 0.834140 O\n0.720589 0.278867 0.654838 O\n0.727487 0.410198 0.282555 O\n0.278297 0.331772 0.474324 O\n0.721335 0.919067 0.776286 O\n0.715898 0.032069 0.414162 O\n0.273193 0.463159 0.093630 O\n0.284102 0.967931 0.585838 O\n0.727281 0.160944 0.033078 O\n0.278665 0.080933 0.223714 O\n0.721618 0.789964 0.165860 O\n0.279411 0.721133 0.345162 O\n0.272719 0.839056 0.966922 O\n",
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},
{
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"structure_string": "Mg1 Au4 Se4 Cl4 O12\n1.0\n4.851967 0.010318 0.043474\n0.485287 9.986224 1.314554\n-0.092176 -0.370798 11.138890\nMg Au Se Cl O\n1 4 4 4 12\ndirect\n0.212700 0.869438 0.127557 Mg\n0.002431 0.577762 0.170725 Au\n0.911512 0.012189 0.967465 Au\n0.992108 0.415805 0.808049 Au\n0.077210 0.992143 0.514755 Au\n0.729180 0.832732 0.325647 Se\n0.094204 0.725775 0.881658 Se\n0.800086 0.297922 0.075210 Se\n0.365807 0.155721 0.727560 Se\n0.311154 0.499338 0.673385 Cl\n0.745358 0.475616 0.320966 Cl\n0.300160 0.175353 0.433171 Cl\n0.858463 0.803913 0.594230 Cl\n0.563298 0.899754 0.198953 O\n0.694446 0.348639 0.928671 O\n0.019187 0.749005 0.254503 O\n0.033522 0.164473 0.062572 O\n0.071953 0.406677 0.093879 O\n0.820752 0.837736 0.898728 O\n0.219606 0.695214 0.038881 O\n0.026915 0.234011 0.748471 O\n0.929417 0.967654 0.344257 O\n0.884360 0.594817 0.872636 O\n0.449011 0.084608 0.864774 O\n0.220493 0.008706 0.680442 O\n",
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}